SIMILAR PATTERNS OF AMINO ACIDS FOR 1X1A_A_SAMA4264_0

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1eq2 ADP-L-GLYCERO-D-MANN
OHEPTOSE 6-EPIMERASE

(Escherichia
coli) 		PF01370
(Epimerase) 		5 GLY A   9
GLY A   7
ILE A  15
LEU A  33
ASP A  35
 NAP  A2400 (-3.4A)
None
None
None
None
 1.04A 1x1aA-1eq2A:
4.9		 1x1aA-1eq2A:
21.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ir6 EXONUCLEASE RECJ

(Thermus
thermophilus) 		PF01368
(DHH)
PF02272
(DHHA1) 		5 ALA A 281
GLY A  88
GLY A  85
ILE A 107
ILE A  91
 None
 1.03A 1x1aA-1ir6A:
undetectable		 1x1aA-1ir6A:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jqg CARBOXYPEPTIDASE A

(Helicoverpa
armigera) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		5 GLY A 296
GLY A 300
ASP A 231
ILE A 230
TYR A 238
 None
 0.92A 1x1aA-1jqgA:
undetectable		 1x1aA-1jqgA:
22.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1knr L-ASPARTATE OXIDASE

(Escherichia
coli) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		5 HIS A 382
ALA A  82
GLY A  74
GLY A 383
LEU A 513
 None
 0.84A 1x1aA-1knrA:
2.3		 1x1aA-1knrA:
22.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1p31 UDP-N-ACETYLMURAMATE
--ALANINE LIGASE

(Haemophilus
influenzae) 		PF01225
(Mur_ligase)
PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		5 ALA A  64
GLY A  25
GLY A  27
ILE A  66
ILE A  87
 None
EPU  A 598 (-3.5A)
EPU  A 598 (-3.7A)
None
EPU  A 598 (-4.9A)
 1.12A 1x1aA-1p31A:
4.9		 1x1aA-1p31A:
22.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pzx HYPOTHETICAL PROTEIN
APC36103

(Geobacillus
stearothermophilus) 		PF02645
(DegV) 		5 ALA A 133
GLY A 125
GLY A 127
ILE A  85
CYH A 154
 None
 0.94A 1x1aA-1pzxA:
undetectable		 1x1aA-1pzxA:
22.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ska 3-PHYTASE A

(Aspergillus
fumigatus) 		PF00328
(His_Phos_2) 		5 ALA A 170
GLY A 117
GLY A 153
ILE A 151
ASP A  12
 None
 0.92A 1x1aA-1skaA:
undetectable		 1x1aA-1skaA:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u1h 5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE

(Arabidopsis
thaliana) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		5 ALA A 546
GLY A 438
GLY A 489
LEU A 735
ILE A 437
 None
MET  A 772 (-3.1A)
None
None
MET  A 772 (-4.6A)
 0.97A 1x1aA-1u1hA:
undetectable		 1x1aA-1u1hA:
19.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wxf NH(3)-DEPENDENT
NAD(+) SYNTHETASE

(Escherichia
coli) 		PF02540
(NAD_synthase) 		5 ALA A 145
GLY A 155
GLY A 151
ILE A 149
ILE A  40
 None
 1.03A 1x1aA-1wxfA:
3.5		 1x1aA-1wxfA:
21.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1x1b CRTF-RELATED PROTEIN

(Chlorobaculum
tepidum) 		PF00891
(Methyltransf_2) 		6 ALA A 157
GLY A 177
ILE A 183
ASP A 227
ILE A 228
TYR A 229
 None
SAH  A4261 (-3.8A)
SAH  A4261 ( 4.8A)
SAH  A4261 (-2.9A)
SAH  A4261 (-3.9A)
SAH  A4261 (-4.8A)
 1.37A 1x1aA-1x1bA:
48.6		 1x1aA-1x1bA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1x1b CRTF-RELATED PROTEIN

(Chlorobaculum
tepidum) 		PF00891
(Methyltransf_2) 		7 TYR A 135
ALA A 154
GLY A 178
ILE A 183
LEU A 201
ASP A 227
TYR A 229
 None
SAH  A4261 ( 4.0A)
SAH  A4261 ( 4.2A)
SAH  A4261 ( 4.8A)
SAH  A4261 (-4.0A)
SAH  A4261 (-2.9A)
SAH  A4261 (-4.8A)
 1.25A 1x1aA-1x1bA:
48.6		 1x1aA-1x1bA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1x1b CRTF-RELATED PROTEIN

(Chlorobaculum
tepidum) 		PF00891
(Methyltransf_2) 		12 TYR A 135
GLU A 147
HIS A 150
ALA A 154
GLY A 177
GLY A 179
ILE A 183
LEU A 201
ASP A 227
ILE A 228
TYR A 229
CYH A 242
 None
SAH  A4261 (-2.7A)
SAH  A4261 (-3.6A)
SAH  A4261 ( 4.0A)
SAH  A4261 (-3.8A)
SAH  A4261 (-3.3A)
SAH  A4261 ( 4.8A)
SAH  A4261 (-4.0A)
SAH  A4261 (-2.9A)
SAH  A4261 (-3.9A)
SAH  A4261 (-4.8A)
SAH  A4261 (-3.0A)
 0.28A 1x1aA-1x1bA:
48.6		 1x1aA-1x1bA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1x1b CRTF-RELATED PROTEIN

(Chlorobaculum
tepidum) 		PF00891
(Methyltransf_2) 		6 TYR A 135
GLU A 147
HIS A 150
GLY A 178
LEU A 201
CYH A 242
 None
SAH  A4261 (-2.7A)
SAH  A4261 (-3.6A)
SAH  A4261 ( 4.2A)
SAH  A4261 (-4.0A)
SAH  A4261 (-3.0A)
 1.11A 1x1aA-1x1bA:
48.6		 1x1aA-1x1bA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xoc OLIGOPEPTIDE-BINDING
PROTEIN APPA

(Bacillus
subtilis) 		PF00496
(SBP_bac_5) 		5 ALA A 225
GLY A  27
ILE A  29
LEU A  24
TYR A 502
 None
 1.09A 1x1aA-1xocA:
undetectable		 1x1aA-1xocA:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xv2 HYPOTHETICAL
PROTEIN, SIMILAR TO
ALPHA-ACETOLACTATE
DECARBOXYLASE

(Staphylococcus
aureus) 		PF03306
(AAL_decarboxy) 		5 HIS A 173
GLY A  35
GLY A 157
LEU A   5
ILE A  76
 ZN  A 801 (-3.5A)
None
None
None
None
 1.10A 1x1aA-1xv2A:
undetectable		 1x1aA-1xv2A:
25.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ycg NITRIC OXIDE
REDUCTASE

(Moorella
thermoacetica) 		PF00258
(Flavodoxin_1)
PF00753
(Lactamase_B) 		5 ALA A 306
GLY A 276
GLY A 390
ILE A 397
CYH A 282
 None
 1.09A 1x1aA-1ycgA:
undetectable		 1x1aA-1ycgA:
22.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z6r MLC PROTEIN

(Escherichia
coli) 		PF00480
(ROK) 		6 GLU A 266
GLY A 225
GLY A 246
ILE A 325
ASP A 195
ILE A 196
 None
 1.44A 1x1aA-1z6rA:
2.3		 1x1aA-1z6rA:
22.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z6r MLC PROTEIN

(Escherichia
coli) 		PF00480
(ROK) 		6 GLU A 266
HIS A 247
GLY A 225
ILE A 325
ASP A 195
ILE A 196
 None
ZN  A 501 (-3.0A)
None
None
None
None
 1.10A 1x1aA-1z6rA:
2.3		 1x1aA-1z6rA:
22.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zn6 PHAGE-RELATED
CONSERVED
HYPOTHETICAL PROTEIN

(Bordetella
bronchiseptica) 		PF02586
(SRAP) 		5 ALA A  20
GLY A 137
ILE A  39
ILE A 184
TYR A 208
 None
 1.10A 1x1aA-1zn6A:
undetectable		 1x1aA-1zn6A:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2aeh FOCAL ADHESION
KINASE 1

(Gallus gallus) 		PF00373
(FERM_M) 		5 TYR A 128
ALA A 294
ILE A 320
ASP A 101
ILE A 359
 None
 1.11A 1x1aA-2aehA:
undetectable		 1x1aA-2aehA:
22.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c11 MEMBRANE COPPER
AMINE OXIDASE

(Homo sapiens) 		PF01179
(Cu_amine_oxid)
PF02727
(Cu_amine_oxidN2)
PF02728
(Cu_amine_oxidN3) 		5 GLU A 367
ALA A 214
GLY A 390
GLY A 387
LEU A 365
 None
 1.06A 1x1aA-2c11A:
undetectable		 1x1aA-2c11A:
19.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cy8 D-PHENYLGLYCINE
AMINOTRANSFERASE

(Pseudomonas
stutzeri) 		PF00202
(Aminotran_3) 		5 GLU A 242
ALA A 270
GLY A 253
LEU A 258
CYH A 327
 None
 1.10A 1x1aA-2cy8A:
undetectable		 1x1aA-2cy8A:
23.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2czc GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Pyrococcus
horikoshii) 		PF01113
(DapB_N)
PF02800
(Gp_dh_C) 		5 ALA A  44
GLY A   6
GLY A  31
ILE A  83
TYR A  99
 None
 0.95A 1x1aA-2czcA:
4.6		 1x1aA-2czcA:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2czc GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Pyrococcus
horikoshii) 		PF01113
(DapB_N)
PF02800
(Gp_dh_C) 		5 ALA A  44
GLY A  11
ILE A  32
ILE A 303
TYR A 274
 None
NAD  A 501 (-3.3A)
None
None
None
 1.11A 1x1aA-2czcA:
4.6		 1x1aA-2czcA:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2dhb HEMOGLOBIN (DEOXY)
(BETA CHAIN)

(Equus caballus) 		PF00042
(Globin) 		5 HIS B  77
GLY B  72
GLY B  74
LEU B  12
ASP B  16
 None
 1.09A 1x1aA-2dhbB:
undetectable		 1x1aA-2dhbB:
16.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iwz 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE

(Homo sapiens) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLU A 394
HIS A 348
ALA A 452
GLY A 388
GLY A 391
 NH4  A1461 (-3.7A)
None
None
None
None
 1.08A 1x1aA-2iwzA:
undetectable		 1x1aA-2iwzA:
24.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ix4 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE

(Arabidopsis
thaliana) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLU A 398
HIS A 350
ALA A 454
GLY A 392
GLY A 395
 K  A1463 (-3.7A)
None
None
6NA  A1462 ( 4.3A)
None
 1.12A 1x1aA-2ix4A:
undetectable		 1x1aA-2ix4A:
19.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o7r CXE CARBOXYLESTERASE

(Actinidia
eriantha) 		PF07859
(Abhydrolase_3) 		5 GLU A 168
ALA A 175
GLY A  93
GLY A  91
ILE A 230
 None
None
4PA  A 369 (-3.6A)
4PA  A 369 ( 3.8A)
4PA  A 369 ( 4.7A)
 1.14A 1x1aA-2o7rA:
2.2		 1x1aA-2o7rA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2olm NUCLEOPORIN-LIKE
PROTEIN RIP

(Homo sapiens) 		PF01412
(ArfGap) 		5 GLU A  87
ALA A 133
GLY A  85
ILE A  92
LEU A  23
 None
None
None
UNX  A1005 ( 4.7A)
None
 1.12A 1x1aA-2olmA:
undetectable		 1x1aA-2olmA:
15.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2oxt NUCLEOSIDE-2'-O-METH
YLTRANSFERASE

(Meaban virus) 		PF01728
(FtsJ) 		5 GLY A  82
GLY A  84
LEU A 106
ASP A 132
ILE A 133
 SAM  A 300 (-3.3A)
SAM  A 300 (-3.5A)
SAM  A 300 (-4.2A)
SAM  A 300 (-3.9A)
SAM  A 300 (-3.8A)
 0.69A 1x1aA-2oxtA:
9.5		 1x1aA-2oxtA:
21.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pg0 ACYL-COA
DEHYDROGENASE

(Geobacillus
kaustophilus) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 ALA A 333
GLY A  85
ILE A 362
LEU A  81
TYR A  30
 None
 1.14A 1x1aA-2pg0A:
undetectable		 1x1aA-2pg0A:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pyw UNCHARACTERIZED
PROTEIN

(Arabidopsis
thaliana) 		PF01636
(APH) 		5 ALA A 233
GLY A 269
GLY A 265
ILE A 235
LEU A 356
 None
 1.12A 1x1aA-2pywA:
undetectable		 1x1aA-2pywA:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qfr PURPLE ACID
PHOSPHATASE

(Phaseolus
vulgaris) 		PF00149
(Metallophos)
PF14008
(Metallophos_C)
PF16656
(Pur_ac_phosph_N) 		5 ALA A 245
ILE A 247
ASP A 361
ILE A 359
TYR A 327
 None
 1.08A 1x1aA-2qfrA:
undetectable		 1x1aA-2qfrA:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rjq ADAMTS-5

(Homo sapiens) 		PF01421
(Reprolysin) 		5 ALA A 361
GLY A 413
ILE A 387
LEU A 438
ILE A 307
 None
 0.88A 1x1aA-2rjqA:
undetectable		 1x1aA-2rjqA:
20.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vge RELA-ASSOCIATED
INHIBITOR

(Homo sapiens) 		PF00023
(Ank)
PF14604
(SH3_9) 		5 TYR A 747
ALA A 762
GLY A 716
GLY A 816
LEU A 697
 None
 1.06A 1x1aA-2vgeA:
undetectable		 1x1aA-2vgeA:
23.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x86 ADP-L-GLYCERO-D-MANN
O-HEPTOSE-6-EPIMERAS
E

(Escherichia
coli) 		PF01370
(Epimerase) 		5 GLY A   9
GLY A   7
ILE A  15
LEU A  33
ASP A  35
 NAP  A 400 (-3.4A)
None
None
None
None
 0.97A 1x1aA-2x86A:
3.6		 1x1aA-2x86A:
24.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ywg GTP-BINDING PROTEIN
LEPA

(Aquifex
aeolicus) 		PF00009
(GTP_EFTU)
PF00679
(EFG_C)
PF03144
(GTP_EFTU_D2)
PF06421
(LepA_C) 		5 TYR A 201
ALA A 195
GLY A 240
GLY A 258
ILE A 214
 None
 1.13A 1x1aA-2ywgA:
undetectable		 1x1aA-2ywgA:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zfu CEREBRAL PROTEIN 1

(Homo sapiens) 		PF05148
(Methyltransf_8) 		5 GLY A 316
GLY A 318
LEU A 335
ASP A 346
CYH A 363
 SAH  A 900 (-3.5A)
SAH  A 900 ( 3.7A)
SAH  A 900 (-4.2A)
SAH  A 900 (-3.6A)
SAH  A 900 (-3.4A)
 0.93A 1x1aA-2zfuA:
12.9		 1x1aA-2zfuA:
19.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zle PROTEASE DO

(Escherichia
coli) 		PF00595
(PDZ)
PF13365
(Trypsin_2) 		5 GLU A 138
GLY A 167
GLY A 131
ILE A 160
ILE A 179
 None
 1.02A 1x1aA-2zleA:
undetectable		 1x1aA-2zleA:
21.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zqq METHYLGLUTACONYL-COA
HYDRATASE

(Homo sapiens) 		PF00378
(ECH_1) 		5 ALA A 193
GLY A 185
GLY A 187
ILE A 165
LEU A 182
 None
 1.11A 1x1aA-2zqqA:
undetectable		 1x1aA-2zqqA:
22.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zxo SINGLE-STRANDED DNA
SPECIFIC EXONUCLEASE
RECJ

(Thermus
thermophilus) 		PF01368
(DHH)
PF02272
(DHHA1) 		5 ALA A 281
GLY A  88
GLY A  85
ILE A 107
ILE A  91
 None
 0.89A 1x1aA-2zxoA:
undetectable		 1x1aA-2zxoA:
21.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3aat ASPARTATE
AMINOTRANSFERASE

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		5 ALA A 390
GLY A 197
ILE A 330
ILE A 198
TYR A 161
 None
 1.10A 1x1aA-3aatA:
5.0		 1x1aA-3aatA:
23.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ahi XYLULOSE
5-PHOSPHATE/FRUCTOSE
6-PHOSPHATE
PHOSPHOKETOLASE

(Bifidobacterium
breve) 		PF03894
(XFP)
PF09363
(XFP_C)
PF09364
(XFP_N) 		5 HIS A 142
ALA A 144
GLY A  94
GLY A 154
ASP A 182
 None
None
None
None
MG  A 826 ( 2.8A)
 1.14A 1x1aA-3ahiA:
2.2		 1x1aA-3ahiA:
18.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3anx SPERMIDINE SYNTHASE

(Thermus
thermophilus) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 TYR A  63
GLU A  88
ALA A 128
GLY A  85
GLY A  87
 None
None
None
MTA  A 315 (-3.2A)
MTA  A 315 (-4.0A)
 1.13A 1x1aA-3anxA:
11.8		 1x1aA-3anxA:
23.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cf4 ACETYL-COA
DECARBOXYLASE/SYNTHA
SE ALPHA SUBUNIT

(Methanosarcina
barkeri) 		PF03063
(Prismane) 		5 TYR A 569
ALA A 596
GLY A 585
GLY A 495
ILE A 281
 None
 1.13A 1x1aA-3cf4A:
2.5		 1x1aA-3cf4A:
17.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dg7 MUCONATE
CYCLOISOMERASE

(Mycolicibacterium
smegmatis) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ALA A 302
GLY A 350
ILE A 353
LEU A 114
ILE A  42
 None
 1.13A 1x1aA-3dg7A:
undetectable		 1x1aA-3dg7A:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e1h PUTATIVE
UNCHARACTERIZED
PROTEIN

(Neurospora
crassa) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		5 ALA A 157
GLY A 377
GLY A 375
ILE A 150
LEU A 270
 None
 1.06A 1x1aA-3e1hA:
undetectable		 1x1aA-3e1hA:
25.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e4f AMINOGLYCOSIDE
N3-ACETYLTRANSFERASE

(Bacillus
anthracis) 		PF02522
(Antibiotic_NAT) 		5 GLY A  42
GLY A 241
ILE A  17
ASP A   3
ILE A   4
 None
 1.15A 1x1aA-3e4fA:
undetectable		 1x1aA-3e4fA:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eaf ABC TRANSPORTER,
SUBSTRATE BINDING
PROTEIN

(Aeropyrum
pernix) 		PF13458
(Peripla_BP_6) 		5 ALA A 317
GLY A  64
GLY A  68
ILE A 327
ASP A  53
 None
 1.09A 1x1aA-3eafA:
3.7		 1x1aA-3eafA:
21.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3euo TYPE III PENTAKETIDE
SYNTHASE

(Neurospora
crassa) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		5 ALA A 157
GLY A 377
GLY A 375
ILE A 150
LEU A 270
 None
 1.12A 1x1aA-3euoA:
undetectable		 1x1aA-3euoA:
24.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3evc RNA-DIRECTED RNA
POLYMERASE NS5

(Yellow fever
virus) 		PF01728
(FtsJ) 		5 GLY A  81
GLY A  83
LEU A 105
ASP A 131
ILE A 132
 SAH  A 901 (-3.4A)
SAH  A 901 (-3.3A)
SAH  A 901 (-4.0A)
SAH  A 901 (-3.7A)
SAH  A 901 (-3.8A)
 0.98A 1x1aA-3evcA:
8.9		 1x1aA-3evcA:
23.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3flb RIFR

(Amycolatopsis
mediterranei) 		PF00975
(Thioesterase) 		5 ALA A  89
GLY A  96
GLY A 100
LEU A  72
ASP A 173
 None
 1.13A 1x1aA-3flbA:
undetectable		 1x1aA-3flbA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3i3l ALKYLHALIDASE CMLS

(Streptomyces
venezuelae) 		PF04820
(Trp_halogenase) 		5 ALA A  18
GLY A 164
GLY A  10
ILE A 161
CYH A 293
 None
FAD  A 600 (-3.4A)
FAD  A 600 (-3.4A)
None
None
 0.94A 1x1aA-3i3lA:
2.4		 1x1aA-3i3lA:
23.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ieh PUTATIVE
METALLOPEPTIDASE

(Shewanella
baltica) 		PF04952
(AstE_AspA) 		5 GLU A  77
HIS A  75
ALA A  72
GLY A 112
GLY A  76
 None
ZN  A 276 ( 3.2A)
None
None
None
 1.12A 1x1aA-3iehA:
undetectable		 1x1aA-3iehA:
21.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jq1 SUSD SUPERFAMILY
PROTEIN

(Bacteroides
vulgatus) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		5 ALA A  75
GLY A  66
GLY A  69
LEU A  56
ILE A 271
 None
 1.11A 1x1aA-3jq1A:
undetectable		 1x1aA-3jq1A:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3moy PROBABLE ENOYL-COA
HYDRATASE

(Mycolicibacterium
smegmatis) 		PF00378
(ECH_1) 		5 GLU A 133
ALA A  29
GLY A 130
GLY A 109
ASP A 159
 EDO  A 262 (-3.5A)
None
None
EDO  A 263 (-3.3A)
None
 1.01A 1x1aA-3moyA:
undetectable		 1x1aA-3moyA:
23.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3oz2 DIGERANYLGERANYLGLYC
EROPHOSPHOLIPID
REDUCTASE

(Thermoplasma
acidophilum) 		PF01494
(FAD_binding_3) 		5 ALA A 284
GLY A  11
GLY A  15
LEU A 107
ILE A  38
 None
FAD  A 501 ( 4.7A)
None
None
None
 1.12A 1x1aA-3oz2A:
undetectable		 1x1aA-3oz2A:
24.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3t34 DYNAMIN-RELATED
PROTEIN 1A, LINKER,
DYNAMIN-RELATED
PROTEIN 1A

(Arabidopsis
thaliana) 		PF00350
(Dynamin_N)
PF01031
(Dynamin_M) 		5 HIS A 282
ALA A 284
GLY A 239
GLY A 279
LEU A 274
 None
 1.11A 1x1aA-3t34A:
undetectable		 1x1aA-3t34A:
22.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tav METHIONINE
AMINOPEPTIDASE

(Mycobacteroides
abscessus) 		PF00557
(Peptidase_M24) 		5 ALA A  31
GLY A 114
GLY A 106
ILE A  28
ILE A 186
 None
 1.14A 1x1aA-3tavA:
undetectable		 1x1aA-3tavA:
23.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tcm ALANINE
AMINOTRANSFERASE 2

(Hordeum vulgare) 		PF00155
(Aminotran_1_2) 		6 ALA A 422
GLY A 443
GLY A 441
LEU A 188
ILE A 171
TYR A 192
 None
 1.44A 1x1aA-3tcmA:
3.8		 1x1aA-3tcmA:
23.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3u02 PUTATIVE
TRANSCRIPTION-ASSOCI
ATED PROTEIN TFIIS

(Pyrococcus
furiosus) 		PF08489
(DUF1743) 		5 ALA A 123
GLY A   6
GLY A 146
ILE A 143
ILE A   5
 None
 1.11A 1x1aA-3u02A:
undetectable		 1x1aA-3u02A:
21.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vv3 DESEASIN MCP-01

(Pseudoalteromonas
sp. SM9913) 		PF00082
(Peptidase_S8) 		5 GLU A 102
ALA A 263
GLY A 105
GLY A 103
LEU A 137
 None
 0.98A 1x1aA-3vv3A:
undetectable		 1x1aA-3vv3A:
22.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wq1 ENDOGLUCANASE A

(Pyrococcus
furiosus) 		PF01670
(Glyco_hydro_12) 		5 ALA A 269
GLY A 262
ILE A 318
LEU A 159
ILE A 145
 None
 1.00A 1x1aA-3wq1A:
undetectable		 1x1aA-3wq1A:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4axs CARBAMATE KINASE

(Mycoplasma
penetrans) 		PF00696
(AA_kinase) 		6 HIS A  45
ALA A   7
GLY A 190
GLY A 186
LEU A 109
ILE A 191
 None
 1.16A 1x1aA-4axsA:
3.7		 1x1aA-4axsA:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4c90 ALPHA-GLUCURONIDASE
GH115

(Bacteroides
ovatus) 		PF15979
(Glyco_hydro_115) 		6 GLU A  61
ALA A  68
GLY A 147
GLY A  99
ILE A 157
ASP A 121
 None
 1.17A 1x1aA-4c90A:
undetectable		 1x1aA-4c90A:
18.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cvq GLUTAMATE-PYRUVATE
AMINOTRANSFERASE
ALAA

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		5 HIS A  84
ALA A  80
GLY A 237
ILE A 286
ILE A 209
 None
None
None
None
PLP  A1240 (-4.4A)
 1.11A 1x1aA-4cvqA:
undetectable		 1x1aA-4cvqA:
25.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dim PHOSPHORIBOSYLGLYCIN
AMIDE SYNTHETASE

(Anaerococcus
prevotii) 		PF01071
(GARS_A) 		5 GLY A  11
GLY A  13
ASP A  53
ILE A  54
CYH A  75
 None
 0.81A 1x1aA-4dimA:
3.7		 1x1aA-4dimA:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4e4j ARGININE DEIMINASE

(Mycoplasma
penetrans) 		PF02274
(Amidinotransf) 		5 GLY A  62
ILE A 446
ASP A 322
ILE A  61
TYR A 323
 None
 1.08A 1x1aA-4e4jA:
undetectable		 1x1aA-4e4jA:
25.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f32 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Burkholderia
vietnamiensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLU A 358
HIS A 313
ALA A 414
GLY A 352
GLY A 355
 None
N32  A 501 (-4.0A)
None
CSU  A 172 ( 4.7A)
None
 1.10A 1x1aA-4f32A:
undetectable		 1x1aA-4f32A:
23.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4fzi PROSTAGLANDIN F
SYNTHASE

(Trypanosoma
cruzi) 		PF00248
(Aldo_ket_red) 		5 GLU A  65
ALA A  39
GLY A  58
GLY A  62
ILE A  47
 None
 0.99A 1x1aA-4fziA:
undetectable		 1x1aA-4fziA:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gky PROTEIN ERGIC-53

(Homo sapiens) 		PF03388
(Lectin_leg-like) 		5 ALA A 203
GLY A 148
ILE A 205
ASP A 142
TYR A 176
 None
 1.03A 1x1aA-4gkyA:
undetectable		 1x1aA-4gkyA:
23.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hds ARSB

(Sporomusa ovata) 		PF02277
(DBI_PRT) 		5 ALA B 244
GLY B 234
ILE B 167
LEU B 263
ILE B 149
 None
 1.13A 1x1aA-4hdsB:
undetectable		 1x1aA-4hdsB:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hst GLUTARYL-7-AMINOCEPH
ALOSPORANIC ACID
ACYLASE ALPHA CHAIN
GLUTARYL-7-AMINOCEPH
ALOSPORANIC ACID
ACYLASE BETA CHAIN

(Pseudomonas;
Pseudomonas) 		PF01804
(Penicil_amidase)
PF01804
(Penicil_amidase) 		5 TYR B  32
HIS B 178
ALA B 195
GLY A 162
ILE B  75
 GLJ  B 601 (-4.9A)
GLJ  B 601 (-4.0A)
None
None
None
 1.14A 1x1aA-4hstB:
undetectable		 1x1aA-4hstB:
19.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ijm CIRCADIAN CLOCK
PROTEIN KINASE KAIC

(Synechococcus
elongatus) 		PF06745
(ATPase) 		5 ALA A 176
GLY A  71
ILE A 134
LEU A  94
ILE A 105
 None
 1.12A 1x1aA-4ijmA:
3.1		 1x1aA-4ijmA:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lgl GLYCINE
DEHYDROGENASE
[DECARBOXYLATING]

(Synechocystis
sp. PCC 6803) 		PF02347
(GDC-P) 		5 HIS A 721
ALA A 596
GLY A 738
GLY A 740
TYR A 131
 None
 1.01A 1x1aA-4lglA:
undetectable		 1x1aA-4lglA:
15.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p4s INTERFERON-INDUCED
GTP-BINDING PROTEIN
MX1

(Homo sapiens) 		PF00350
(Dynamin_N)
PF01031
(Dynamin_M) 		5 ALA A 146
GLY A 156
GLY A 152
ILE A 150
CYH A 105
 None
 1.04A 1x1aA-4p4sA:
undetectable		 1x1aA-4p4sA:
21.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p4s INTERFERON-INDUCED
GTP-BINDING PROTEIN
MX1

(Homo sapiens) 		PF00350
(Dynamin_N)
PF01031
(Dynamin_M) 		5 ALA B 146
GLY B 156
GLY B 152
ILE B 150
CYH B 105
 None
 1.06A 1x1aA-4p4sB:
2.3		 1x1aA-4p4sB:
23.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p72 PHENYLALANINE--TRNA
LIGASE BETA SUBUNIT

(Pseudomonas
aeruginosa) 		PF01588
(tRNA_bind)
PF03147
(FDX-ACB)
PF03483
(B3_4)
PF03484
(B5) 		5 ALA A  12
GLY A 173
LEU A 169
ASP A 354
ILE A 257
 None
 1.13A 1x1aA-4p72A:
undetectable		 1x1aA-4p72A:
19.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q60 PROLINE RACEMASE

(Burkholderia
multivorans) 		PF05544
(Pro_racemase) 		5 HIS A  91
ALA A 289
GLY A  62
LEU A  86
ILE A  51
 None
 1.06A 1x1aA-4q60A:
undetectable		 1x1aA-4q60A:
24.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qiw DNA-DIRECTED RNA
POLYMERASE
DNA-DIRECTED RNA
POLYMERASE

(Thermococcus
kodakarensis;
Thermococcus
kodakarensis) 		PF00623
(RNA_pol_Rpb1_2)
PF04983
(RNA_pol_Rpb1_3)
PF04997
(RNA_pol_Rpb1_1)
PF04998
(RNA_pol_Rpb1_5)
PF05000
(RNA_pol_Rpb1_4)
PF00562
(RNA_pol_Rpb2_6)
PF04560
(RNA_pol_Rpb2_7)
PF04561
(RNA_pol_Rpb2_2)
PF04563
(RNA_pol_Rpb2_1)
PF04565
(RNA_pol_Rpb2_3)
PF04566
(RNA_pol_Rpb2_4)
PF04567
(RNA_pol_Rpb2_5) 		5 ALA A 460
GLY A 464
ILE A 332
LEU B 997
TYR B 994
 None
 1.08A 1x1aA-4qiwA:
undetectable		 1x1aA-4qiwA:
18.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rhz CRY23AA1

(Bacillus
thuringiensis) 		PF03318
(ETX_MTX2) 		5 ALA A  91
GLY A 215
GLY A  88
ILE A  95
CYH A 167
 None
 1.05A 1x1aA-4rhzA:
undetectable		 1x1aA-4rhzA:
18.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zmh UNCHARACTERIZED
PROTEIN

(Saccharophagus
degradans) 		PF15979
(Glyco_hydro_115) 		5 ALA A  74
GLY A 165
ILE A 163
ASP A 128
ILE A 129
 None
None
None
PO4  A1002 ( 4.7A)
None
 0.97A 1x1aA-4zmhA:
undetectable		 1x1aA-4zmhA:
18.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ztx COBALAMIN-INDEPENDEN
T METHIONINE
SYNTHASE

(Neurospora
crassa) 		PF01717
(Meth_synt_2)
PF08267
(Meth_synt_1) 		5 ALA A 550
GLY A 442
GLY A 493
LEU A 739
ILE A 441
 None
 0.97A 1x1aA-4ztxA:
undetectable		 1x1aA-4ztxA:
18.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5bz4 BETA-KETOTHIOLASE

(Mycolicibacterium
smegmatis) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 GLU A 387
ALA A 114
GLY A  91
GLY A 366
ILE A 391
 None
 1.10A 1x1aA-5bz4A:
undetectable		 1x1aA-5bz4A:
23.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cov NAEGLERIA GRUBERI
RNA LIGASE

(Naegleria
gruberi) 		PF09414
(RNA_ligase) 		5 GLU A 193
ALA A 206
GLY A 186
ILE A 212
ILE A 253
 None
 1.11A 1x1aA-5covA:
undetectable		 1x1aA-5covA:
22.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dzt CYLM

(Enterococcus
faecalis) 		PF05147
(LANC_like)
PF13575
(DUF4135) 		5 ALA A 988
GLY A 974
GLY A 972
ILE A 703
LEU A 953
 None
 1.10A 1x1aA-5dztA:
undetectable		 1x1aA-5dztA:
16.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fg3 PROBABLE TRANSLATION
INITIATION FACTOR
IF-2

(Aeropyrum
pernix) 		PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2)
PF11987
(IF-2)
PF14578
(GTP_EFTU_D4) 		5 ALA A 534
GLY A 502
ILE A 504
LEU A 585
ILE A 572
 None
 1.09A 1x1aA-5fg3A:
2.0		 1x1aA-5fg3A:
22.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h8y SULFITE REDUCTASE
[FERREDOXIN],
CHLOROPLASTIC

(Zea mays) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		5 ALA A 199
GLY A 421
LEU A 478
ILE A 440
CYH A 459
 None
 0.97A 1x1aA-5h8yA:
undetectable		 1x1aA-5h8yA:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hab RIBONUCLEASE J

(Methanolobus
psychrophilus) 		PF07521
(RMMBL)
PF12706
(Lactamase_B_2) 		5 TYR A  12
ALA A  95
GLY A  34
ILE A  91
CYH A  80
 None
 1.08A 1x1aA-5habA:
3.1		 1x1aA-5habA:
24.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hp6 EXTRACELLULAR
ARABINANASE

(Geobacillus
stearothermophilus) 		PF04616
(Glyco_hydro_43)
PF13385
(Laminin_G_3)
PF16369
(GH43_C) 		5 TYR A 228
GLY A 254
GLY A 259
ILE A 295
ILE A 237
 None
None
None
None
TRS  A 903 (-4.4A)
 1.09A 1x1aA-5hp6A:
undetectable		 1x1aA-5hp6A:
18.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5hsi PUTATIVE
DECARBOXYLASE

(Lactobacillus
brevis) 		PF00282
(Pyridoxal_deC) 		6 ALA A 446
GLY A 152
GLY A 138
ILE A 154
ASP A 407
ILE A 405
 None
 1.38A 1x1aA-5hsiA:
undetectable		 1x1aA-5hsiA:
21.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5idb NATTERIN-3

(Crassostrea
gigas) 		no annotation 5 GLY B  50
GLY B   9
ILE B  12
ILE B  61
CYH B  44
 None
 1.03A 1x1aA-5idbB:
undetectable		 1x1aA-5idbB:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kxj L-ASPARTATE OXIDASE

(Salmonella
enterica) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		5 HIS A 382
ALA A  82
GLY A  74
GLY A 383
LEU A 513
 None
 0.88A 1x1aA-5kxjA:
undetectable		 1x1aA-5kxjA:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mlk ACETYL-COA
CARBOXYLASE

(Mycobacterium
tuberculosis) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 ALA A 225
GLY A 114
ILE A 325
ASP A 107
ILE A 106
 None
 1.01A 1x1aA-5mlkA:
undetectable		 1x1aA-5mlkA:
20.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5mrt LYTIC ENDOPEPTIDASE
PREPROENZYME

(Lysobacter sp.
XL1) 		no annotation 5 TYR A  86
ALA A 160
GLY A 150
GLY A  24
ILE A 191
 None
 1.11A 1x1aA-5mrtA:
undetectable		 1x1aA-5mrtA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xzd ENOYL-COA HYDRATASE

(Roseovarius
nubinhibens) 		no annotation 5 GLU A 132
ALA A  27
GLY A 129
GLY A 108
ASP A 158
 ACY  A 301 (-3.5A)
None
None
ACY  A 301 ( 4.5A)
None
 0.99A 1x1aA-5xzdA:
undetectable		 1x1aA-5xzdA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yem CATALASE

(Mycothermus
thermophilus) 		no annotation 5 ALA A 599
GLY A 606
GLY A 553
ILE A 634
LEU A 579
 None
 0.98A 1x1aA-5yemA:
3.3		 1x1aA-5yemA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yfb DIPEPTIDYL PEPTIDASE
3

(Armillaria
tabescens) 		no annotation 5 HIS A 288
ALA A 290
GLY A 283
LEU A 250
ASP A 245
 None
 1.02A 1x1aA-5yfbA:
undetectable		 1x1aA-5yfbA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6c66 CRISPR-ASSOCIATED
PROTEIN, CSE4 FAMILY

(Thermobifida
fusca) 		no annotation 5 ALA B 366
GLY B 350
GLY B 336
ILE B 334
ASP B 345
 None
 0.85A 1x1aA-6c66B:
undetectable		 1x1aA-6c66B:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6gnf -

(-) 		no annotation 5 ALA A 433
GLY A 344
ILE A 453
LEU A 339
ILE A 349
 None
 1.04A 1x1aA-6gnfA:
3.7		 1x1aA-6gnfA:
undetectable